5,6-bis(azanyl)-2-(5-tert-butylsulfonyl-2-propoxy-phenyl)-1H-pyrimidin-4-one

Systemtic Name: 5,6-bis(azanyl)-2-(5-tert-butylsulfonyl-2-propoxy-phenyl)-1H-pyrimidin-4-one Openeye Name: 5,6-diamino-2-(5-tert-butylsulfonyl-2-propoxy-phenyl)-1H-pyrimidin-4-one CAS Name: 5,6-diamino-2-(5-tert-butylsulfonyl-2-propoxyphenyl)-1H-pyrimidin-4-one IUPAC Name: 5,6-diamino-2-(5-tert-butylsulfonyl-2-propoxyphenyl)-1H-pyrimidin-4-one Traditional Name: 5,6-diamino-2-(5-tert-butylsulfonyl-2-propoxy-phenyl)-1H-pyrimidin-4-one Formula: C17H24N4O4S MolecularWeight: 380.46186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)C(C)(C)C)C2=NC(=O)C(=C(N2)N)N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)C(C)(C)C)C2=NC(=O)C(=C(N2)N)N

InChI

InChI=1S/C17H24N4O4S/c1-5-8-25-12-7-6-10(26(23,24)17(2,3)4)9-11(12)15-20-14(19)13(18)16(22)21-15/h6-7,9H,5,8,18H2,1-4H3,(H3,19,20,21,22)